Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:44:49 UTC
Update Date2025-03-24 22:12:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02026138
Frequency0.6
Structure
Chemical FormulaC9H17N
Molecular Mass139.1361
SMILESCC1(C)C2CCCC1NC2
InChI KeyRUHSSPNDTIIQQI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazepanes
Subclass azepanes
Direct Parent azepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • pyrrolidines
  • Substituents
  • secondary aliphatic amine
  • azacycle
  • secondary amine
  • aliphatic heteropolycyclic compound
  • azepane
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • amine